CAS RN: 7071-83-2
9-FLUORENONE-4-CARBONYL CHLORIDE
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260305 | 10g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS7071-83-2
- Purity/Analytical Methods: >99.0%
7071-83-2 / 9-oxofluorene-4-carbonyl chloride
Basic Information
CAS
7071-83-2
Multi CAS
No
Molecular Formula
C14H7CLO2
Molecular Weight
242.650000
Exact Mass
242.013457
InChI
InChI=1S/C14H7ClO2/c15-14(17)11-7-3-6-10-12(11)8-4-1-2-5-9(8)13(10)16/h1-7H
InChIKey
XKCGWCQMEUASJF-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
12
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
65.49
TPSA
34.14
LogP / Solubility
WLOGP
3.28
MLOGP
2.89
XLogP3
3.6
Consensus LogP
3.26
Log S (ESOL)
-3.87
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.92
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.08
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.87
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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